#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a0s s GLU 424 N 0.00 0.86 -0.80 3.17 -1.05 -1.26 -1.42 118.70 118.20 3a0s s GLU 424 Ca 0.00 -0.64 -0.03 0.00 -0.15 0.00 0.00 54.97 54.15 3a0s s GLU 424 Cb 0.00 0.37 0.00 0.00 -0.44 0.00 0.00 34.13 34.06 3a0s s GLU 424 CO 0.00 -0.29 0.69 2.41 0.95 0.00 0.00 175.26 179.02 3a0s n THR 425 N 0.31 -2.62 -2.51 1.83 -1.04 -1.12 -4.94 114.28 104.19 3a0s n THR 425 Ca -0.17 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.29 3a0s n THR 425 Cb 0.61 -3.46 -0.03 0.00 -1.82 0.00 0.00 70.33 65.63 3a0s n THR 425 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3a0s s ALA 426 N -3.21 3.47 -0.11 2.41 0.00 -0.79 -4.62 121.76 118.91 3a0s s ALA 426 Ca 0.22 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.78 3a0s s ALA 426 Cb -0.10 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.53 3a0s s ALA 426 CO 0.45 -0.72 -0.22 0.42 0.00 0.00 0.00 175.76 175.69 3a0s s ILE 427 N 2.15 1.91 -0.13 0.00 1.01 -1.26 -0.82 121.20 124.06 3a0s s ILE 427 Ca 0.54 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 60.28 3a0s s ILE 427 Cb -0.23 -1.67 0.02 0.00 0.01 0.00 0.00 42.46 40.58 3a0s s ILE 427 CO 0.21 0.53 -0.14 -0.63 0.00 0.00 0.00 174.94 174.90 3a0s s ILE 428 N 0.53 1.52 -0.10 2.92 1.01 -0.33 -2.22 121.20 124.54 3a0s s ILE 428 Ca -0.15 -0.62 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 3a0s s ILE 428 Cb -0.17 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.85 3a0s s ILE 428 CO 0.05 0.45 -0.06 -0.89 0.00 0.00 0.00 174.94 174.49 3a0s s THR 429 N 1.33 3.78 0.03 2.92 2.01 -0.56 -0.08 115.64 125.07 3a0s s THR 429 Ca 0.01 -0.43 0.07 0.00 0.31 0.00 0.00 61.69 61.65 3a0s s THR 429 Cb -0.13 -2.58 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 3a0s s THR 429 CO -0.08 0.57 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.48 3a0s s LEU 430 N -0.43 2.60 1.01 4.42 1.43 0.22 -0.32 118.68 127.60 3a0s s LEU 430 Ca 0.06 -0.40 -0.16 0.00 -1.03 0.00 0.00 54.13 52.61 3a0s s LEU 430 Cb -0.12 -1.51 0.20 0.00 0.03 0.00 0.00 46.19 44.79 3a0s s LEU 430 CO 0.02 0.27 1.22 -0.94 0.23 0.00 0.00 176.35 177.15 3a0s s SER 431 N -1.31 2.67 0.06 2.29 1.04 0.54 -1.37 113.70 117.61 3a0s s SER 431 Ca 0.14 0.54 0.15 0.00 0.48 0.00 0.00 55.95 57.26 3a0s s SER 431 Cb -0.10 -0.78 0.64 0.00 0.10 0.00 0.00 66.02 65.88 3a0s s SER 431 CO 0.04 -3.03 1.47 2.29 0.98 0.00 0.00 173.24 174.99 3a0s n LYS 432 N -4.02 0.04 -0.26 4.02 2.85 -0.58 -0.95 118.16 119.27 3a0s n LYS 432 Ca 0.12 0.32 0.12 0.00 -1.05 0.00 0.00 58.31 57.82 3a0s n LYS 432 Cb 0.59 -1.58 0.27 0.00 -0.65 0.00 0.00 35.03 33.66 3a0s n LYS 432 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3a0s n ASP 433 N -1.66 3.54 0.00 -5.58 8.00 -1.26 -4.96 116.55 114.63 3a0s n ASP 433 Ca 0.03 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.54 3a0s n ASP 433 Cb 0.16 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.92 3a0s n ASP 433 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a0s n GLY 434 N 1.55 0.69 3.81 0.44 0.00 -0.12 -4.98 105.19 106.58 3a0s n GLY 434 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 3a0s n GLY 434 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a0s s ARG 435 N -0.36 4.24 -0.20 1.61 0.52 -1.26 -1.99 118.95 121.51 3a0s s ARG 435 Ca 0.00 0.82 -0.29 0.00 -0.52 0.00 0.00 55.73 55.74 3a0s s ARG 435 Cb 0.00 -3.04 -0.01 0.00 0.52 0.00 0.00 34.95 32.42 3a0s s ARG 435 CO 0.00 0.50 1.26 0.42 0.02 0.00 0.00 175.30 177.50 3a0s s ILE 436 N -1.35 4.27 -0.14 1.52 1.01 0.37 -0.34 121.20 126.53 3a0s s ILE 436 Ca 0.37 1.51 0.10 0.00 0.00 0.00 0.00 60.65 62.63 3a0s s ILE 436 Cb -0.18 -4.06 -0.14 0.00 0.01 0.00 0.00 42.46 38.10 3a0s s ILE 436 CO 0.21 -0.22 0.27 0.35 0.00 0.00 0.00 174.94 175.55 3a0s n THR 437 N 5.58 0.00 -3.90 2.92 -2.24 0.56 -0.46 114.28 116.75 3a0s n THR 437 Ca 0.14 -0.24 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 3a0s n THR 437 Cb 0.45 0.49 -0.13 0.00 -2.10 0.00 0.00 70.33 69.05 3a0s n THR 437 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3a0s s GLU 438 N -2.44 0.14 -0.29 -0.78 2.02 -1.12 -4.95 118.70 111.28 3a0s s GLU 438 Ca -0.01 -0.18 0.05 0.00 0.02 0.00 0.00 54.97 54.84 3a0s s GLU 438 Cb 0.07 0.06 0.19 0.00 0.10 0.00 0.00 34.13 34.54 3a0s s GLU 438 CO 0.40 -0.02 0.54 -0.46 0.02 0.00 0.00 175.26 175.74 3a0s s TRP 439 N -0.51 -1.63 0.85 1.61 -0.11 -1.25 -1.49 118.94 116.40 3a0s s TRP 439 Ca -0.06 0.90 -0.09 0.00 1.22 0.00 0.00 56.10 58.07 3a0s s TRP 439 Cb -0.04 0.20 0.16 0.00 -1.50 0.00 0.00 33.47 32.29 3a0s s TRP 439 CO -0.00 -1.05 1.17 0.54 -4.62 0.00 0.00 176.95 172.98 3a0s s ASN 440 N 2.75 3.72 0.43 5.86 4.22 -0.94 -4.62 114.94 126.36 3a0s s ASN 440 Ca 0.10 0.00 0.12 0.00 -2.14 0.00 0.00 52.86 50.95 3a0s s ASN 440 Cb -0.11 -0.21 0.94 0.00 1.28 0.00 0.00 41.25 43.15 3a0s s ASN 440 CO -0.27 -2.31 1.98 0.11 -2.04 0.00 0.00 177.10 174.57 3a0s h LYS 441 N -1.12 0.11 -0.58 3.55 1.79 -1.93 -1.14 116.57 117.26 3a0s h LYS 441 Ca -0.41 -0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 57.95 3a0s h LYS 441 Cb 1.25 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.86 3a0s h LYS 441 CO 0.40 0.25 0.01 0.87 -1.08 0.00 0.00 179.45 179.89 3a0s h LYS 442 N 0.11 0.99 -0.47 3.15 1.79 -1.92 -0.99 116.57 119.23 3a0s h LYS 442 Ca 0.02 -0.30 -0.08 0.00 -2.18 0.00 0.00 60.65 58.12 3a0s h LYS 442 Cb 0.30 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.83 3a0s h LYS 442 CO 0.02 0.97 -0.02 0.00 -1.08 0.00 0.00 179.45 179.34 3a0s h ALA 443 N 1.08 1.08 -0.41 3.86 0.00 -1.62 -0.15 119.26 123.10 3a0s h ALA 443 Ca 0.17 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3a0s h ALA 443 Cb 0.52 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3a0s h ALA 443 CO 0.03 0.58 0.25 0.93 0.00 0.00 0.00 179.25 181.04 3a0s h GLU 444 N 0.74 0.50 -0.36 0.00 5.08 -0.79 0.27 114.58 120.02 3a0s h GLU 444 Ca 0.14 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 3a0s h GLU 444 Cb 0.48 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3a0s h GLU 444 CO 0.02 0.33 -0.29 1.96 -1.00 0.00 0.00 179.01 180.03 3a0s h GLN 445 N 0.51 0.77 -0.01 2.33 4.20 -0.91 0.13 115.11 122.13 3a0s h GLN 445 Ca 0.16 -0.35 -0.19 0.00 0.06 0.00 0.00 58.65 58.33 3a0s h GLN 445 Cb -0.02 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 27.76 3a0s h GLN 445 CO -0.06 0.97 -0.74 1.25 -0.67 0.00 0.00 178.83 179.58 3a0s h LEU 446 N 0.66 0.68 0.00 1.46 5.85 -0.85 -3.37 115.31 119.74 3a0s h LEU 446 Ca 0.08 -0.74 0.00 0.00 0.84 0.00 0.00 57.88 58.06 3a0s h LEU 446 Cb 0.82 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3a0s h LEU 446 CO 0.07 1.33 -1.08 0.49 -0.34 0.00 0.00 178.44 178.90 3a0s n PHE 447 N -4.09 0.00 -1.22 1.25 3.72 0.07 -5.00 117.46 112.18 3a0s n PHE 447 Ca -0.10 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.25 3a0s n PHE 447 Cb 0.74 -0.12 -0.02 0.00 -0.94 0.00 0.00 39.48 39.13 3a0s n PHE 447 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a0s n GLY 448 N 1.44 0.73 3.32 1.37 0.00 0.44 -5.03 105.19 107.46 3a0s n GLY 448 Ca 0.01 -0.82 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 3a0s n GLY 448 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a0s s LEU 449 N -1.19 2.37 0.39 0.99 1.43 -1.23 -5.06 118.68 116.37 3a0s s LEU 449 Ca 0.00 -0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 52.44 3a0s s LEU 449 Cb 0.00 -1.48 -0.09 0.00 0.03 0.00 0.00 46.19 44.65 3a0s s LEU 449 CO 0.00 0.22 1.01 -0.54 0.23 0.00 0.00 176.35 177.27 3a0s s LYS 450 N -0.00 4.25 0.26 1.70 1.02 -1.26 -4.12 119.74 121.57 3a0s s LYS 450 Ca -0.06 1.40 -0.02 0.00 0.02 0.00 0.00 55.97 57.30 3a0s s LYS 450 Cb -0.15 -2.52 0.52 0.00 -0.52 0.00 0.00 37.83 35.17 3a0s s LYS 450 CO 0.05 -0.05 1.71 -0.22 -0.92 0.00 0.00 175.35 175.92 3a0s h LYS 451 N 2.50 0.38 0.00 1.68 3.64 -1.91 -0.42 116.57 122.44 3a0s h LYS 451 Ca -0.48 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3a0s h LYS 451 Cb 1.20 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.94 3a0s h LYS 451 CO 0.62 0.25 -0.01 1.05 -2.27 0.00 0.00 179.45 179.10 3a0s h GLU 452 N 0.39 0.00 0.00 1.90 9.09 -1.94 0.32 114.58 124.34 3a0s h GLU 452 Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.86 3a0s h GLU 452 Cb 0.75 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.85 3a0s h GLU 452 CO -0.46 0.01 -0.26 0.09 0.05 0.00 0.00 179.01 178.43 3a0s n ASN 453 N -3.11 0.59 0.00 3.06 5.03 -0.18 -4.26 115.26 116.39 3a0s n ASN 453 Ca -0.00 0.31 0.00 0.00 0.87 0.00 0.00 54.58 55.76 3a0s n ASN 453 Cb 0.25 -0.30 0.00 0.00 -1.02 0.00 0.00 39.78 38.70 3a0s n ASN 453 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 3a0s n VAL 454 N -1.98 0.00 -1.71 2.41 0.24 -0.70 -4.99 118.33 111.60 3a0s n VAL 454 Ca 0.05 -0.04 -0.43 0.00 -2.04 0.00 0.00 64.34 61.88 3a0s n VAL 454 Cb 0.40 0.51 -0.02 0.00 -1.47 0.00 0.00 33.84 33.26 3a0s n VAL 454 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3a0s n LEU 455 N -1.35 3.84 0.00 1.34 4.77 0.02 -1.45 117.00 124.16 3a0s n LEU 455 Ca 0.00 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 3a0s n LEU 455 Cb 0.00 -1.52 0.00 0.00 -2.33 0.00 0.00 43.42 39.57 3a0s n LEU 455 CO 0.00 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.55 3a0s n GLY 456 N 2.14 2.25 3.90 -0.72 0.00 0.39 -4.95 105.19 108.21 3a0s n GLY 456 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 3a0s n GLY 456 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a0s s ARG 457 N -0.46 3.63 0.03 1.61 0.52 -0.53 -4.56 118.95 119.19 3a0s s ARG 457 Ca 0.00 0.07 -0.30 0.00 -0.52 0.00 0.00 55.73 54.98 3a0s s ARG 457 Cb 0.00 -2.58 -0.06 0.00 0.52 0.00 0.00 34.95 32.84 3a0s s ARG 457 CO 0.00 0.12 1.31 1.03 0.02 0.00 0.00 175.30 177.78 3a0s s ARG 458 N -3.79 4.34 0.29 3.54 1.81 -1.26 -0.48 118.95 123.40 3a0s s ARG 458 Ca 0.45 1.88 0.01 0.00 -1.72 0.00 0.00 55.73 56.36 3a0s s ARG 458 Cb -0.10 -3.44 0.56 0.00 -0.45 0.00 0.00 34.95 31.51 3a0s s ARG 458 CO 0.32 -0.44 1.84 1.25 -0.68 0.00 0.00 175.30 177.60 3a0s h LEU 459 N 7.59 0.92 -0.86 2.53 5.85 -1.76 -1.00 115.31 128.58 3a0s h LEU 459 Ca -0.39 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.37 3a0s h LEU 459 Cb 1.19 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.08 3a0s h LEU 459 CO 0.87 0.50 0.00 2.29 -0.34 0.00 0.00 178.44 181.76 3a0s n LYS 460 N -4.60 0.17 0.01 1.25 2.85 -1.26 -1.29 118.16 115.29 3a0s n LYS 460 Ca 0.18 0.48 0.14 0.00 -1.05 0.00 0.00 58.31 58.06 3a0s n LYS 460 Cb 0.34 -1.88 0.60 0.00 -0.65 0.00 0.00 35.03 33.44 3a0s n LYS 460 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3a0s n ASP 461 N -2.22 0.07 -4.64 -5.58 8.00 -0.38 -4.41 116.55 107.40 3a0s n ASP 461 Ca 0.01 0.50 -0.40 0.00 0.71 0.00 0.00 54.79 55.61 3a0s n ASP 461 Cb 0.18 -0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.69 3a0s n ASP 461 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3a0s s LEU 462 N -3.13 4.09 0.03 0.64 1.43 -0.41 -4.99 118.68 116.34 3a0s s LEU 462 Ca 0.14 0.72 -0.35 0.00 -1.03 0.00 0.00 54.13 53.60 3a0s s LEU 462 Cb 0.18 -2.84 -0.14 0.00 0.03 0.00 0.00 46.19 43.42 3a0s s LEU 462 CO 0.54 -0.33 1.61 -2.65 0.23 0.00 0.00 176.35 175.74 3a0s n PRO 463 N 5.48 1.79 0.00 1.29 -0.02 -1.26 -1.09 135.00 141.18 3a0s n PRO 463 Ca -0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3a0s n PRO 463 Cb 0.49 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 3a0s n PRO 463 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3a0s n ASP 464 N 4.14 0.00 -0.78 2.55 8.00 -1.26 -4.86 116.55 124.34 3a0s n ASP 464 Ca 0.20 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.78 3a0s n ASP 464 Cb 0.25 0.00 0.15 0.00 -0.02 0.00 0.00 41.12 41.49 3a0s n ASP 464 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3a0s n PHE 465 N -1.72 0.34 -0.18 1.24 3.72 -0.25 -4.64 117.46 115.98 3a0s n PHE 465 Ca 0.00 -0.26 -0.06 0.00 -0.05 0.00 0.00 57.45 57.09 3a0s n PHE 465 Cb 0.00 -0.01 0.04 0.00 -0.94 0.00 0.00 39.48 38.57 3a0s n PHE 465 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3a0s h GLU 466 N 3.01 0.61 -0.12 -1.08 3.07 -1.76 0.76 114.58 119.07 3a0s h GLU 466 Ca 0.00 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.80 3a0s h GLU 466 Cb 0.75 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 28.52 3a0s h GLU 466 CO 0.00 0.40 -0.03 1.49 -1.40 0.00 0.00 179.01 179.47 3a0s h GLU 467 N 0.63 0.23 -1.01 2.33 4.81 -1.94 -0.82 114.58 118.82 3a0s h GLU 467 Ca 0.21 -0.09 0.09 0.00 -0.13 0.00 0.00 59.36 59.44 3a0s h GLU 467 Cb 0.01 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 3a0s h GLU 467 CO -0.09 0.54 0.64 0.82 -0.73 0.00 0.00 179.01 180.19 3a0s h ILE 468 N -0.09 1.03 -0.70 2.32 2.04 -1.82 -0.36 117.51 119.92 3a0s h ILE 468 Ca 0.03 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 3a0s h ILE 468 Cb 0.46 -0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.32 3a0s h ILE 468 CO 0.01 0.20 0.30 1.23 0.00 0.00 0.00 178.15 179.89 3a0s h GLY 469 N 1.11 1.11 1.00 5.37 0.00 -0.67 -1.15 103.07 109.83 3a0s h GLY 469 Ca 0.46 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 47.14 3a0s h GLY 469 CO -0.21 0.55 0.07 1.76 0.00 0.00 0.00 176.54 178.72 3a0s h SER 470 N 0.99 0.84 -0.85 0.19 0.02 -0.26 -2.12 113.55 112.35 3a0s h SER 470 Ca 0.23 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 3a0s h SER 470 Cb 0.18 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 3a0s h SER 470 CO -0.02 0.89 0.44 0.58 -1.14 0.00 0.00 176.83 177.58 3a0s h VAL 471 N 0.75 1.26 -0.75 2.27 2.07 -0.84 -1.96 116.25 119.04 3a0s h VAL 471 Ca 0.16 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 3a0s h VAL 471 Cb 0.42 0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 3a0s h VAL 471 CO 0.01 0.30 0.36 0.00 0.02 0.00 0.00 177.57 178.26 3a0s h ALA 472 N 1.24 1.22 -0.35 1.67 0.00 -1.00 -0.13 119.26 121.90 3a0s h ALA 472 Ca 0.30 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3a0s h ALA 472 Cb 0.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3a0s h ALA 472 CO -0.04 0.60 0.22 0.93 0.00 0.00 0.00 179.25 180.96 3a0s h GLU 473 N 1.07 0.48 -0.62 0.00 5.08 -0.88 -0.64 114.58 119.06 3a0s h GLU 473 Ca 0.26 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3a0s h GLU 473 Cb 0.11 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3a0s h GLU 473 CO -0.03 0.35 0.31 1.03 -1.00 0.00 0.00 179.01 179.67 3a0s h SER 474 N 0.47 0.80 -0.50 1.42 0.87 -0.81 -1.53 113.55 114.27 3a0s h SER 474 Ca 0.13 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 3a0s h SER 474 Cb -0.01 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.71 3a0s h SER 474 CO -0.03 0.69 0.33 0.58 -0.53 0.00 0.00 176.83 177.88 3a0s h VAL 475 N 0.85 1.12 0.18 2.23 2.07 -0.83 -1.21 116.25 120.65 3a0s h VAL 475 Ca 0.22 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 3a0s h VAL 475 Cb 0.09 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 3a0s h VAL 475 CO -0.03 0.12 -0.08 0.15 0.02 0.00 0.00 177.57 177.75 3a0s h PHE 476 N 0.67 -0.22 -0.54 1.57 3.57 -0.93 -0.91 116.94 120.14 3a0s h PHE 476 Ca 0.19 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 3a0s h PHE 476 Cb -0.06 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 3a0s h PHE 476 CO -0.04 -0.12 0.36 0.93 -2.23 0.00 0.00 178.31 177.21 3a0s h GLU 477 N -0.26 0.60 -0.01 1.11 5.08 -1.14 -1.88 114.58 118.10 3a0s h GLU 477 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3a0s h GLU 477 Cb 0.20 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3a0s h GLU 477 CO 0.04 0.40 -0.21 0.09 -1.00 0.00 0.00 179.01 178.33 3a0s n ASN 478 N -4.47 0.92 -2.12 1.42 3.02 -0.47 -4.95 115.26 108.61 3a0s n ASN 478 Ca 0.06 -0.85 -0.15 0.00 -0.03 0.00 0.00 54.58 53.61 3a0s n ASN 478 Cb 0.15 0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 3a0s n ASN 478 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3a0s n LYS 479 N -0.67 -1.82 -4.48 3.52 5.02 -0.36 -4.96 118.16 114.40 3a0s n LYS 479 Ca 0.13 0.78 -0.21 0.00 -2.02 0.00 0.00 58.31 56.99 3a0s n LYS 479 Cb 0.33 -5.30 -0.15 0.00 -0.02 0.00 0.00 35.03 29.89 3a0s n LYS 479 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3a0s s GLU 480 N -4.48 1.08 0.71 1.97 2.02 -1.18 -4.97 118.70 113.85 3a0s s GLU 480 Ca 0.00 -0.37 -0.13 0.00 0.02 0.00 0.00 54.97 54.49 3a0s s GLU 480 Cb 0.00 -1.00 0.03 0.00 0.10 0.00 0.00 34.13 33.26 3a0s s GLU 480 CO 0.00 0.16 1.11 -1.25 0.02 0.00 0.00 175.26 175.30 3a0s s PRO 481 N 0.08 2.51 -0.03 0.39 0.04 -1.26 -4.75 135.00 131.98 3a0s s PRO 481 Ca -0.02 1.37 0.02 0.00 0.04 0.00 0.00 61.00 62.40 3a0s s PRO 481 Cb -0.08 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.55 3a0s s PRO 481 CO 0.01 -1.48 -0.06 0.08 0.04 0.00 0.00 177.00 175.59 3a0s s VAL 482 N -2.48 0.54 -0.17 -0.36 1.01 -0.65 -5.00 120.40 113.29 3a0s s VAL 482 Ca 0.66 -0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.43 3a0s s VAL 482 Cb -0.20 -0.52 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 3a0s s VAL 482 CO 0.47 0.20 -0.10 0.12 0.00 0.00 0.00 175.10 175.78 3a0s s PHE 483 N 0.46 2.87 -0.08 5.22 5.36 -1.26 -0.75 117.98 129.80 3a0s s PHE 483 Ca -0.06 -0.83 0.02 0.00 -0.96 0.00 0.00 56.93 55.10 3a0s s PHE 483 Cb -0.10 -1.95 -0.02 0.00 -0.34 0.00 0.00 43.02 40.61 3a0s s PHE 483 CO 0.00 -0.38 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.75 3a0s s LEU 484 N 0.86 2.83 0.38 6.12 1.43 0.48 -4.99 118.68 125.79 3a0s s LEU 484 Ca -0.03 -0.20 0.08 0.00 -1.03 0.00 0.00 54.13 52.95 3a0s s LEU 484 Cb -0.15 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 3a0s s LEU 484 CO 0.00 0.28 0.13 0.54 0.23 0.00 0.00 176.35 177.54 3a0s s ASN 485 N -0.34 4.43 -1.46 2.29 2.20 -1.26 -0.22 114.94 120.58 3a0s s ASN 485 Ca 0.04 -0.98 -0.06 0.00 -0.94 0.00 0.00 52.86 50.92 3a0s s ASN 485 Cb -0.13 -0.56 0.04 0.00 -2.00 0.00 0.00 41.25 38.61 3a0s s ASN 485 CO 0.02 -0.41 0.67 0.49 -2.94 0.00 0.00 177.10 174.93 3a0s n PHE 486 N -1.15 -1.87 -2.99 1.54 3.72 -1.03 -4.94 117.46 110.75 3a0s n PHE 486 Ca -0.02 0.81 -0.42 0.00 -0.05 0.00 0.00 57.45 57.77 3a0s n PHE 486 Cb 0.63 -3.84 -0.05 0.00 -0.94 0.00 0.00 39.48 35.28 3a0s n PHE 486 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 3a0s s TYR 487 N -3.64 3.14 -0.04 1.38 6.14 -0.26 -4.83 117.35 119.25 3a0s s TYR 487 Ca 0.26 0.57 -0.26 0.00 0.64 0.00 0.00 57.07 58.27 3a0s s TYR 487 Cb -0.13 -3.30 -0.04 0.00 0.42 0.00 0.00 41.96 38.91 3a0s s TYR 487 CO 0.86 -0.67 0.81 0.21 0.64 0.00 0.00 175.55 177.40 3a0s s LYS 488 N 2.98 4.49 -0.06 4.97 2.20 -1.26 -1.38 119.74 131.67 3a0s s LYS 488 Ca 0.30 1.09 -0.03 0.00 -0.36 0.00 0.00 55.97 56.98 3a0s s LYS 488 Cb -0.14 -3.45 0.04 0.00 -1.51 0.00 0.00 37.83 32.77 3a0s s LYS 488 CO 0.15 0.03 0.10 0.12 -0.36 0.00 0.00 175.35 175.40 3a0s s PHE 489 N 0.83 -0.03 0.00 4.03 2.19 -0.59 -5.01 117.98 119.40 3a0s s PHE 489 Ca 0.43 0.39 0.00 0.00 0.33 0.00 0.00 56.93 58.08 3a0s s PHE 489 Cb -0.19 -0.40 0.00 0.00 -1.31 0.00 0.00 43.02 41.12 3a0s s PHE 489 CO 0.22 -0.23 0.00 0.41 1.83 0.00 0.00 175.22 177.45 3a0s n GLY 490 N 5.31 3.15 0.63 13.12 0.00 -1.26 -2.73 105.19 123.41 3a0s n GLY 490 Ca -0.04 -0.17 0.13 0.00 0.00 0.00 0.00 46.02 45.95 3a0s n GLY 490 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3a0s n GLU 491 N 13.51 1.81 -4.31 1.61 2.13 -1.26 -4.99 120.64 129.15 3a0s n GLU 491 Ca 0.00 -1.26 -0.16 0.00 0.66 0.00 0.00 57.16 56.40 3a0s n GLU 491 Cb 0.00 -1.47 -0.10 0.00 0.27 0.00 0.00 31.44 30.13 3a0s n GLU 491 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3a0s s ARG 492 N -2.06 1.26 -0.11 5.31 0.52 -1.10 -5.14 118.95 117.62 3a0s s ARG 492 Ca 0.33 -1.62 -0.06 0.00 -0.52 0.00 0.00 55.73 53.86 3a0s s ARG 492 Cb 0.20 -0.59 -0.04 0.00 0.52 0.00 0.00 34.95 35.04 3a0s s ARG 492 CO 0.35 -0.06 0.12 0.71 0.02 0.00 0.00 175.30 176.44 3a0s s TYR 493 N -3.42 3.54 0.10 -0.53 2.02 -1.26 -1.55 117.35 116.25 3a0s s TYR 493 Ca 0.26 0.48 0.07 0.00 -0.37 0.00 0.00 57.07 57.50 3a0s s TYR 493 Cb 0.05 -1.92 -0.03 0.00 -0.40 0.00 0.00 41.96 39.66 3a0s s TYR 493 CO 0.07 0.70 -0.17 -0.06 -1.57 0.00 0.00 175.55 174.52 3a0s s PHE 494 N -1.02 1.52 0.11 2.71 0.08 -0.48 -4.76 117.98 116.15 3a0s s PHE 494 Ca 0.15 -0.46 -0.28 0.00 0.12 0.00 0.00 56.93 56.46 3a0s s PHE 494 Cb -0.12 -0.83 -0.06 0.00 -0.57 0.00 0.00 43.02 41.44 3a0s s PHE 494 CO 0.04 0.15 0.86 -0.80 -0.10 0.00 0.00 175.22 175.38 3a0s s ASN 495 N -2.01 7.41 -0.08 1.36 0.01 0.34 -1.10 114.94 120.87 3a0s s ASN 495 Ca 0.05 1.68 0.01 0.00 -0.71 0.00 0.00 52.86 53.88 3a0s s ASN 495 Cb -0.09 -2.54 0.02 0.00 0.41 0.00 0.00 41.25 39.06 3a0s s ASN 495 CO 0.04 0.03 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.94 3a0s s ILE 496 N -0.35 0.95 -0.07 0.60 1.01 0.69 -1.36 121.20 122.68 3a0s s ILE 496 Ca 0.42 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.76 3a0s s ILE 496 Cb -0.23 -0.93 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 3a0s s ILE 496 CO 0.27 0.33 -0.09 -0.60 0.00 0.00 0.00 174.94 174.86 3a0s s ARG 497 N 1.14 2.71 -0.18 2.79 3.52 -0.05 -0.39 118.95 128.50 3a0s s ARG 497 Ca -0.06 -0.58 0.01 0.00 -0.13 0.00 0.00 55.73 54.97 3a0s s ARG 497 Cb -0.14 -2.55 0.02 0.00 -1.56 0.00 0.00 34.95 30.72 3a0s s ARG 497 CO -0.02 0.65 -0.19 -0.06 -0.81 0.00 0.00 175.30 174.87 3a0s s PHE 498 N -0.77 2.78 -0.23 5.12 0.40 0.07 -1.28 117.98 124.08 3a0s s PHE 498 Ca 0.12 -1.55 0.01 0.00 -0.60 0.00 0.00 56.93 54.90 3a0s s PHE 498 Cb -0.11 -1.92 0.06 0.00 0.51 0.00 0.00 43.02 41.56 3a0s s PHE 498 CO 0.01 -0.76 -0.05 -1.12 0.70 0.00 0.00 175.22 174.00 3a0s s SER 499 N 1.24 3.76 0.51 1.36 0.01 0.35 -1.63 113.70 119.30 3a0s s SER 499 Ca 0.03 -1.13 -0.21 0.00 1.31 0.00 0.00 55.95 55.95 3a0s s SER 499 Cb -0.13 -1.15 -0.06 0.00 0.21 0.00 0.00 66.02 64.88 3a0s s SER 499 CO -0.11 -0.23 1.20 -2.16 0.41 0.00 0.00 173.24 172.35 3a0s s PRO 500 N 1.42 3.44 0.05 12.44 0.04 -1.26 -1.00 135.00 150.13 3a0s s PRO 500 Ca -0.05 1.84 -0.00 0.00 0.04 0.00 0.00 61.00 62.82 3a0s s PRO 500 Cb -0.19 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3a0s s PRO 500 CO -0.06 -0.83 -0.04 -0.59 0.04 0.00 0.00 177.00 175.52 3a0s s PHE 501 N -1.55 0.52 0.16 0.56 -0.71 -0.68 -4.90 117.98 111.39 3a0s s PHE 501 Ca 0.69 -0.90 0.07 0.00 -1.04 0.00 0.00 56.93 55.75 3a0s s PHE 501 Cb -0.30 -0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 41.10 3a0s s PHE 501 CO 0.35 -0.29 0.02 1.03 -1.34 0.00 0.00 175.22 174.99 3a0s s ARG 502 N -3.24 2.48 0.12 1.99 0.52 -1.26 -0.71 118.95 118.85 3a0s s ARG 502 Ca 0.02 -1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 53.89 3a0s s ARG 502 Cb 0.03 -2.42 -0.07 0.00 0.52 0.00 0.00 34.95 33.01 3a0s s ARG 502 CO -0.07 0.47 1.11 1.21 0.02 0.00 0.00 175.30 178.05 3a0s s ASN 503 N -2.87 7.23 0.31 0.23 3.84 -0.23 -4.86 114.94 118.59 3a0s s ASN 503 Ca 0.28 2.02 0.10 0.00 0.21 0.00 0.00 52.86 55.46 3a0s s ASN 503 Cb -0.10 -2.59 0.49 0.00 -0.55 0.00 0.00 41.25 38.50 3a0s s ASN 503 CO 0.19 -0.29 1.70 0.00 -2.79 0.00 0.00 177.10 175.90 3a0s h ALA 504 N 5.79 1.13 0.26 1.71 0.00 -1.96 0.11 119.26 126.30 3a0s h ALA 504 Ca -0.43 -0.45 -0.34 0.00 0.00 0.00 0.00 54.91 53.69 3a0s h ALA 504 Cb 1.21 -0.08 0.04 0.00 0.00 0.00 0.00 17.79 18.96 3a0s h ALA 504 CO 0.75 0.63 -1.48 0.87 0.00 0.00 0.00 179.25 180.02 3a0s h LYS 505 N 0.06 0.54 0.00 0.00 1.79 -1.98 -3.36 116.57 113.61 3a0s h LYS 505 Ca -0.00 -0.93 0.00 0.00 -2.18 0.00 0.00 60.65 57.54 3a0s h LYS 505 Cb 0.89 0.35 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 3a0s h LYS 505 CO 0.07 1.44 -1.63 0.25 -1.08 0.00 0.00 179.45 178.51 3a0s n THR 506 N -3.72 0.00 -0.97 -0.16 -2.24 -1.22 -4.98 114.28 101.00 3a0s n THR 506 Ca -0.17 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 3a0s n THR 506 Cb 1.11 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 3a0s n THR 506 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3a0s n GLN 507 N -1.98 -1.23 -2.78 -0.78 1.13 0.39 -4.99 117.38 107.14 3a0s n GLN 507 Ca -0.01 0.31 -0.38 0.00 -1.94 0.00 0.00 57.00 54.98 3a0s n GLN 507 Cb 0.47 -4.32 -0.06 0.00 0.11 0.00 0.00 30.24 26.44 3a0s n GLN 507 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3a0s s LEU 508 N 0.00 4.44 -0.01 1.08 1.43 -1.25 -4.74 118.68 119.63 3a0s s LEU 508 Ca 0.00 1.86 -0.30 0.00 -1.03 0.00 0.00 54.13 54.66 3a0s s LEU 508 Cb 0.00 -3.86 -0.08 0.00 0.03 0.00 0.00 46.19 42.28 3a0s s LEU 508 CO 0.00 0.01 1.94 -0.76 0.23 0.00 0.00 176.35 177.77 3a0s s LEU 509 N -1.76 4.29 0.00 1.79 1.43 -1.26 -1.07 118.68 122.11 3a0s s LEU 509 Ca 0.47 2.49 0.07 0.00 -1.03 0.00 0.00 54.13 56.12 3a0s s LEU 509 Cb -0.21 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.47 3a0s s LEU 509 CO 0.26 -1.15 0.50 1.21 0.23 0.00 0.00 176.35 177.41 3a0s n GLU 510 N 7.63 2.46 -2.74 1.70 2.13 0.11 -4.83 120.64 127.10 3a0s n GLU 510 Ca 0.21 -0.47 0.00 0.00 0.66 0.00 0.00 57.16 57.56 3a0s n GLU 510 Cb 0.42 -0.97 0.00 0.00 0.27 0.00 0.00 31.44 31.15 3a0s n GLU 510 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3a0s n GLY 511 N 0.79 -0.05 2.79 8.31 0.00 -1.21 -1.53 105.19 114.29 3a0s n GLY 511 Ca 0.03 -1.34 -0.15 0.00 0.00 0.00 0.00 46.02 44.56 3a0s n GLY 511 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a0s s VAL 512 N -3.02 -0.06 -0.17 1.61 1.01 -0.47 -1.68 120.40 117.62 3a0s s VAL 512 Ca 0.00 0.22 -0.16 0.00 0.00 0.00 0.00 61.98 62.04 3a0s s VAL 512 Cb 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 36.24 3a0s s VAL 512 CO 0.00 0.09 0.39 -0.63 0.00 0.00 0.00 175.10 174.95 3a0s s ILE 513 N 1.11 5.23 -0.19 2.22 1.01 -0.17 -0.61 121.20 129.79 3a0s s ILE 513 Ca -0.09 0.73 -0.03 0.00 0.00 0.00 0.00 60.65 61.26 3a0s s ILE 513 Cb -0.13 -3.73 -0.01 0.00 0.01 0.00 0.00 42.46 38.60 3a0s s ILE 513 CO -0.03 0.31 -0.06 -0.63 0.00 0.00 0.00 174.94 174.52 3a0s s ILE 514 N 0.88 3.38 -0.13 2.92 1.01 0.88 -0.50 121.20 129.66 3a0s s ILE 514 Ca 0.20 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.37 3a0s s ILE 514 Cb -0.14 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.84 3a0s s ILE 514 CO 0.07 0.46 -0.20 -0.89 0.00 0.00 0.00 174.94 174.39 3a0s s THR 515 N 1.01 1.86 -0.14 2.92 2.01 -0.40 -1.19 115.64 121.71 3a0s s THR 515 Ca 0.00 -0.86 0.02 0.00 0.31 0.00 0.00 61.69 61.15 3a0s s THR 515 Cb -0.15 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.71 3a0s s THR 515 CO -0.00 0.51 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.62 3a0s s ILE 516 N 0.83 2.35 0.04 1.82 1.01 -0.00 -0.87 121.20 126.39 3a0s s ILE 516 Ca -0.08 -0.88 0.03 0.00 0.00 0.00 0.00 60.65 59.72 3a0s s ILE 516 Cb -0.15 -1.96 -0.02 0.00 0.01 0.00 0.00 42.46 40.33 3a0s s ILE 516 CO -0.01 0.53 -0.11 -1.81 0.00 0.00 0.00 174.94 173.55 3a0s s ASP 517 N 0.77 1.22 0.00 3.58 1.01 -0.46 -1.89 116.67 120.90 3a0s s ASP 517 Ca -0.07 -0.44 0.11 0.00 0.71 0.00 0.00 52.55 52.87 3a0s s ASP 517 Cb -0.16 -0.05 0.68 0.00 1.01 0.00 0.00 42.92 44.41 3a0s s ASP 517 CO -0.00 -0.05 1.12 0.47 0.21 0.00 0.00 175.17 176.92